propan-2-yl 2-[3-(benzenesulfonyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-[3-(benzenesulfonyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-[3-(benzenesulfonyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y503-1893 |
| Compound Name: | propan-2-yl 2-[3-(benzenesulfonyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 435.56 |
| Molecular Formula: | C21 H25 N O5 S2 |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(CCS(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6773 |
| logD: | 0.6007 |
| logSw: | -4.1862 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.3 |
| InChI Key: | MAGVBBLKNAETAQ-UHFFFAOYSA-N |